Structure
Basic information
Pretty formula | Fe3P2H3O11 |
Full formula | Fe12P8H12O44 |
Tags | Triiron(III) trihydroxide bis(phosphate(V)); Kryzhanovskite |
Constituent elements | Fe; H; O; P; |
Number of elements | 4 |
Number of sites | 76 |
Volume | 774.78365 Å3 |
Density | 3.50203 g/cm3 |
Source | Materials Project |
Space group
Spacegroup Number | 60 |
Hermann Mauguin | Pbcn |
Hall | -P 2n 2ab |
Crystal System | Orthorhombic |
Calculated Energies
Total energy | Energy per atom | Formation energy per atom | Band gap | Total magnetization | Energy above hull |
---|---|---|---|---|---|
-496.01255 eV | -6.52648 eV | -2.09073 eV | 2.06590 eV | 59.96155 eV | 0.03183 eV |